2-[(4-chloranyl-3-nitro-phenyl)sulfonyl-prop-2-enyl-amino]-N-[(1-methylpyrrol-2-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(4-chloranyl-3-nitro-phenyl)sulfonyl-prop-2-enyl-amino]-N-[(1-methylpyrrol-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: 2-[allyl-(4-chloro-3-nitro-phenyl)sulfonyl-amino]-N-benzyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: 2-[(4-chloro-3-nitrophenyl)sulfonyl-prop-2-enylamino]-N-[(1-methyl-2-pyrrolyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(4-chloro-3-nitrophenyl)sulfonyl-prop-2-enylamino]-N-[(1-methylpyrrol-2-yl)methyl]acetamide Traditional Name: 2-[allyl-(4-chloro-3-nitro-phenyl)sulfonyl-amino]-N-benzyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C24H25ClN4O5S MolecularWeight: 516.9971

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(CC2=CC=CC=C2)C(=O)CN(CC=C)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC=C1CN(CC2=CC=CC=C2)C(=O)CN(CC=C)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H25ClN4O5S/c1-3-13-28(35(33,34)21-11-12-22(25)23(15-21)29(31)32)18-24(30)27(16-19-8-5-4-6-9-19)17-20-10-7-14-26(20)2/h3-12,14-15H,1,13,16-18H2,2H3